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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine protease 1' and Ligand = 'BDBM50288454'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine protease 1


(Bos taurus (bovine))
BDBM50288454
PNG
(CHEMBL317527 | N-[3-((5S,20R,22aR)-5-Benzyl-4,7,18...)
Show SMILES NC(=N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCNC(=O)C1=O
Show InChI InChI=1S/C31H47N7O5/c32-31(33)35-19-11-15-23-27(40)29(42)34-18-10-5-3-1-2-4-9-17-26(39)36-24(21-22-13-7-6-8-14-22)30(43)38-20-12-16-25(38)28(41)37-23/h6-8,13-14,23-25H,1-5,9-12,15-21H2,(H,34,42)(H,36,39)(H,37,41)(H4,32,33,35)/t23-,24+,25-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
2.10n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of bovine trypsin


Bioorg Med Chem Lett 6: 2947-2952 (1996)


Article DOI: 10.1016/S0960-894X(96)00554-9
BindingDB Entry DOI: 10.7270/Q2FX79F5
More data for this
Ligand-Target Pair